1-cyclopentyl-3-[[4-oxidanylidene-4-(4-pentylphenyl)butanoyl]amino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[4-oxidanylidene-4-(4-pentylphenyl)butanoyl]amino]thiourea Openeye Name: 1-cyclopentyl-3-[[4-oxo-4-(4-pentylphenyl)butanoyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[1,4-dioxo-4-(4-pentylphenyl)butyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[4-oxo-4-(4-pentylphenyl)butanoyl]amino]thiourea Traditional Name: 1-[[4-(4-amylphenyl)-4-keto-butanoyl]amino]-3-cyclopentyl-thiourea Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2CCCC2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2CCCC2

InChI

InChI=1S/C21H31N3O2S/c1-2-3-4-7-16-10-12-17(13-11-16)19(25)14-15-20(26)23-24-21(27)22-18-8-5-6-9-18/h10-13,18H,2-9,14-15H2,1H3,(H,23,26)(H2,22,24,27)